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Methyl (S)-3-(4'-methoxyphenyl)-3-[N-(2'-methoxy-6'-methylphenyl)-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-2,2-dimethylpropionate

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Methyl (S)-3-(4'-methoxyphenyl)-3-[N-(2'-methoxy-6'-methylphenyl)-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-2,2-dimethylpropionate
SpectraBase Compound ID EfNuaM0ZgpZ
InChI InChI=1S/C35H40N2O7/c1-21-13-12-16-26(43-8)27(21)36(28(35(5,6)33(41)44-9)22-17-19-23(42-7)20-18-22)32(40)29(34(2,3)4)37-30(38)24-14-10-11-15-25(24)31(37)39/h10-20,28-29H,1-9H3/t28-,29+/m0/s1
InChIKey XQMBCYXCCAENDP-URLMMPGGSA-N
Mol Weight 600.7 g/mol
Molecular Formula C35H40N2O7
Exact Mass 600.283552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPtJz19TWqs
Name Methyl (S)-3-(4'-methoxyphenyl)-3-[N-(2'-methoxy-6'-methylphenyl)-N-((S)-N',N'-phthaloyl-tert-leucyl)]amino-2,2-dimethylpropionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H40N2O7
InChI InChI=1S/C35H40N2O7/c1-21-13-12-16-26(43-8)27(21)36(28(35(5,6)33(41)44-9)22-17-19-23(42-7)20-18-22)32(40)29(34(2,3)4)37-30(38)24-14-10-11-15-25(24)31(37)39/h10-20,28-29H,1-9H3/t28-,29+/m0/s1
InChIKey XQMBCYXCCAENDP-URLMMPGGSA-N
Molecular Weight 600.712 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@](C(N([C@](C(C(=O)OC)(C)C)(c1ccc(cc1)OC)[H])c1c(OC)cccc1C)=O)(C(C)(C)C)[H])=O
SPLASH splash10-014j-0090300000-6fe41126e778ad774d5f
Source of Spectrum QE-6-2040-8
Synonyms Methyl (3S)-3-{[(2S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3,3-dimethylbutanoyl]-2-methoxy-6-methylanilino}-3-(4-methoxyphenyl)-2,2-dimethylpropanoate
Wiley ID 844760